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Record W3106914653 · doi:10.1002/anie.202014682

Mixed Noble‐Gas Compounds of Krypton(II) and Xenon(VI); [F<sub>5</sub>Xe(FKrF)AsF<sub>6</sub>] and [F<sub>5</sub>Xe(FKrF)<sub>2</sub>AsF<sub>6</sub>]

2020· article· en· W3106914653 on OpenAlexafffund
Matic Lozinšek, Hélène P. A. Mercier, Gary J. Schrobilgen

Bibliographic record

VenueAngewandte Chemie International Edition · 2020
Typearticle
Languageen
FieldChemistry
TopicInorganic Fluorides and Related Compounds
Canadian institutionsMcMaster University
FundersFP7 People: Marie-Curie ActionsNatural Sciences and Engineering Research Council of CanadaJavna Agencija za Raziskovalno Dejavnost RSCompute Canada
KeywordsXenonKryptonChemistryNoble gasLigand (biochemistry)Physical chemistryCrystallography

Abstract

fetched live from OpenAlex

Abstract The coordination chemistry of KrF 2 has been limited in contrast with that of XeF 2 , which exhibits a far richer coordination chemistry with main‐group and transition‐metal cations. In the present work, reactions of [XeF 5 ][AsF 6 ] with KrF 2 in anhydrous HF solvent afforded [F 5 Xe(FKrF)AsF 6 ] and [F 5 Xe(FKrF) 2 AsF 6 ], the first mixed krypton/xenon compounds. X‐ray crystal structures and Raman spectra show the KrF 2 ligands and [AsF 6 ] − anions are F‐coordinated to the xenon atoms of the [XeF 5 ] + cations. Quantum‐chemical calculations are consistent with essentially noncovalent ligand−xenon bonds that may be described in terms of σ‐hole bonding. These complexes significantly extend the XeF 2 –KrF 2 analogy and the limited chemistry of krypton by introducing a new class of coordination compound in which KrF 2 functions as a ligand that coordinates to xenon(VI). The HF solvates, [F 5 Xe(FH)AsF 6 ] and [F 5 Xe(FH)SbF 6 ], are also characterized in this study and they provide rare examples of HF coordinated to xenon(VI).

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.001
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Research integrity
Consensus categoriesMeta-epidemiology (narrow), Research integrity
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.034
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.001
Meta-epidemiology (narrow)0.0020.002
Meta-epidemiology (broad)0.0020.001
Bibliometrics0.0010.001
Science and technology studies0.0010.001
Scholarly communication0.0010.002
Open science0.0010.001
Research integrity0.0020.003
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.012
GPT teacher head0.207
Teacher spread0.195 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; both teacher heads agree on what is shown here.

Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations25
Published2020
Admission routes2
Has abstractyes

Explore more

Same venueAngewandte Chemie International EditionSame topicInorganic Fluorides and Related CompoundsFrench-language works237,207